# generated using pymatgen
data_Li4Ti5Cr3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92530969
_cell_length_b   5.92530969
_cell_length_c   9.55997821
_cell_angle_alpha   89.91443796
_cell_angle_beta   89.91443796
_cell_angle_gamma   60.01402792
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti5Cr3O16
_chemical_formula_sum   'Li4 Ti5 Cr3 O16'
_cell_volume   290.71695999
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Li  Li0  1  0.33567900  0.33567900  0.10547800  1
  Li  Li1  1  0.00093500  0.00093500  0.00685900  1
  Li  Li2  1  0.00065600  0.00065600  0.50349600  1
  Li  Li3  1  0.66630800  0.66630800  0.60164900  1
  Ti  Ti4  1  0.82605000  0.82605000  0.27661700  1
  Ti  Ti5  1  0.65649000  0.16535900  0.78142600  1
  Ti  Ti6  1  0.33237600  0.33237600  0.50258200  1
  Ti  Ti7  1  0.16535900  0.65649000  0.78142600  1
  Ti  Ti8  1  0.65939900  0.65939900  0.00819300  1
  Cr  Cr9  1  0.17082100  0.17082100  0.78872600  1
  Cr  Cr10  1  0.82992100  0.34034900  0.28804800  1
  Cr  Cr11  1  0.34034900  0.82992100  0.28804800  1
  O  O12  1  0.66346400  0.16564600  0.40415400  1
  O  O13  1  0.48045600  0.48045600  0.65893000  1
  O  O14  1  0.33730000  0.33730000  0.89699300  1
  O  O15  1  0.00112300  0.00112300  0.69122700  1
  O  O16  1  0.99813300  0.99813300  0.19321200  1
  O  O17  1  0.16564600  0.66346400  0.40415400  1
  O  O18  1  0.48386700  0.03989100  0.66067500  1
  O  O19  1  0.03989100  0.48386700  0.66067500  1
  O  O20  1  0.83255100  0.83255100  0.90270100  1
  O  O21  1  0.16825200  0.16825200  0.40573400  1
  O  O22  1  0.96320900  0.52377400  0.15874900  1
  O  O23  1  0.52377400  0.96320900  0.15874900  1
  O  O24  1  0.67240800  0.67240800  0.39610300  1
  O  O25  1  0.82914000  0.33359400  0.90459200  1
  O  O26  1  0.52250100  0.52250100  0.15835100  1
  O  O27  1  0.33359400  0.82914000  0.90459200  1
